SCHEMBL3477481

SCHEMBL3477481

Cn1ccc2cc(-c3nc4ccccc4o3)ccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.60
FAAH O00519 12/20 0.55
NPC1 O15118 5/20 0.53
RAB9A P51151 4/20 0.50
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HCRTR1 O43613 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
HSD11B1 P28845 1/20 0.50
NFKB1 P19838 1/20 0.50
STAT1 P42224 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
USP2 O75604 1/20 0.49
MAPT P10636 1/20 0.49
TSHR P16473 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2174585 0.78 NPC1 (0.66) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL3476128 0.78 FAAH (0.58) APPFAAHNPC1RAB9AKDM4E
SCHEMBL2633271 0.77 NPC1 (0.64) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL19846146 0.77 NPC1 (0.64) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL2688110 0.77 NPC1 (0.55) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL30727501 0.76 NPC1 (0.62) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL1913541 0.76 NPC1 (0.62) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL1507814 0.75 APP (1.00) APPFAAH
SCHEMBL31170 0.75 NPC1 (0.81) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL17691814 0.74 NPC1 (0.60) NPC1RAB9AKDM4EALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed